2-methyl-1,3-phenylene bis(4-nitrobenzene-1-sulfonate)
Chemical Structure Depiction of
2-methyl-1,3-phenylene bis(4-nitrobenzene-1-sulfonate)
2-methyl-1,3-phenylene bis(4-nitrobenzene-1-sulfonate)
Compound characteristics
| Compound ID: | 3257-0264 |
| Compound Name: | 2-methyl-1,3-phenylene bis(4-nitrobenzene-1-sulfonate) |
| Molecular Weight: | 494.45 |
| Molecular Formula: | C19 H14 N2 O10 S2 |
| Smiles: | Cc1c(cccc1OS(c1ccc(cc1)[N+]([O-])=O)(=O)=O)OS(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.117 |
| logD: | 4.117 |
| logSw: | -4.3407 |
| Hydrogen bond acceptors count: | 18 |
| Polar surface area: | 138.698 |
| InChI Key: | YNAGPKFPRCWSBE-UHFFFAOYSA-N |